SCHEMBL5030308

SCHEMBL5030308

Oc1ccc2c(c1)Cc1cc3cc(O)ccc3cc1-2

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 1/20 0.50
ESR1 P03372 11/20 0.46
ESR2 Q92731 11/20 0.46
CYP1A2 P05177 1/20 0.43
DRD2 P14416 1/20 0.42
DRD1 P21728 1/20 0.42
DRD5 P21918 1/20 0.42
DRD3 P35462 1/20 0.42
CYP3A4 P08684 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
HIF1A Q16665 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CYP17A1 P05093 1/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
CYP19A1 P11511 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5269525 1.00 HSD17B1 (0.50) HSD17B1ESR1ESR2CYP1A2DRD2
SCHEMBL21453381 0.92 ESR1 (0.44) HSD17B1ESR1ESR2CYP1A2DRD2
SCHEMBL5319753 0.89 HSD17B1 (0.50) HSD17B1ESR1ESR2CYP1A2DRD2
SCHEMBL5028772 0.89 ESR1 (0.46) HSD17B1ESR1ESR2CYP1A2CYP3A4
SCHEMBL14007352 0.87 CYP1A2 (0.48) ESR1ESR2CYP1A2DRD2DRD1
SCHEMBL25940944 0.86 CYP1A2 (0.47) ESR1ESR2CYP1A2DRD2DRD1
SCHEMBL29439100 0.83 HSD17B1 (0.64) HSD17B1ESR1ESR2DRD2DRD1
SCHEMBL788852 0.83 HSD17B1 (0.64) HSD17B1ESR1ESR2DRD2DRD1
Fluorene SCHEMBL28670106 0.76 CYP1A2 (0.58) HSD17B1ESR1ESR2CYP1A2DRD2
SCHEMBL3198655 0.74 ALDH1A1 (0.41) ESR1ESR2CYP1A2MAOAMAOB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7335659-B2 Substituted 10-aryl-11H-benzo[b]fluorenes and 7-aryl-5, 6-dihydro-benzo[a]anthracenes for selective effects on estrogen receptors N.V. ORGANON (NL) 2008-02-26 US disclosed
EP-1272471-B1 NON-STEROIDAL, TETRACYCLIC COMPOUNDS FOR ESTROGEN-RELATED TREATMENTS ORGANON NV (NL) 2007-10-03 EP disclosed
EP-1272471-B1 NON-STEROIDAL, TETRACYCLIC COMPOUNDS FOR ESTROGEN-RELATED TREATMENTS ORGANON NV (NL) 2007-10-03 EP disclosed
EP-1478613-B1 SUBSTITUTED 10-ARYL-11H-BENZO¬B|FLUORENES FOR SELECTIVE EFFECTS ON ESTROGEN RECEPTORS AKZO NOBEL NV (NL) 2006-05-24 EP disclosed
US-20050159405-A1 Substituted 10-aryl-11h-benzo[b]fluourenes and 7-aryl-5, 6-dihydro-benzo[a]anthracenes for selective effects on estrogen receptors AKZO NOBEL, N.V. PATENT DEPARTMENT (NL) 2005-07-21 US disclosed
US-6686371-B2 HAVING AN 11H-BENZO(B)FLUORENE, AN 11H-INDENO-(1,2-B) QUINOLINE, A BENZ(A)ANTHRACENE OR ANALOGOUS SKELETON AND AN AFFINITY FOR THE ESTROGEN RECEPTOR; CONTRACEPTIVES; MENOPAUSAL COMPLAINTS, OSTEOPOROSIS; ANTITUMOR AGENTS AKZO NOBEL N.V. (NL) 2004-02-03 US disclosed
US-20030144313-A1 Non-steroidal, tetracylic compounds for estrogen-related treatments N.V. ORGANON (NL) 2003-07-31 US disclosed
EP-1272471-A1 NON-STEROIDAL, TETRACYCLIC COMPOUNDS FOR ESTROGEN-RELATED TREATMENTS Akzo Nobel N.V. (NL) 2003-01-08 EP disclosed
WO-2001072713-A1 NON-STEROIDAL, TETRACYCLIC COMPOUNDS FOR ESTROGEN-RELATED TREATMENTS AKZO NOBEL N.V. (NL) 2001-10-04 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050159405-A1 Substituted 10-aryl-11h-benzo[b]fluourenes and 7-aryl-5, 6-dihydro-benzo[a]anthracenes for selective effects on estrogen receptors ESR1, ESR2, ESRRA HSD17B1 348/4885ESR1 1/4885ESR2 2/4885
US-20030144313-A1 Non-steroidal, tetracylic compounds for estrogen-related treatments ESRRA, ESRRB, ESRRG HSD17B1 61/4885ESR1 6/4885ESR2 4/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.